(2S)-2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]propanamide

Systemtic Name: (2S)-2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]propanamide Openeye Name: (2S)-2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]propanamide CAS Name: (2S)-2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]propanamide IUPAC Name: (2S)-2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]propanamide Traditional Name: (2S)-2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]propionamide Formula: C20H22ClN5O3S2 MolecularWeight: 480.00338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C)SC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N(C)C)SC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C20H22ClN5O3S2/c1-13(30-20-24-17(12-26(20)22)14-7-5-4-6-8-14)19(27)23-15-9-10-16(21)18(11-15)31(28,29)25(2)3/h4-13H,22H2,1-3H3,(H,23,27)/t13-/m0/s1